REMARK  Name = BDB017283
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        4.745  -0.102   0.672  0.00  0.00    +0.037 A 
ATOM      2  C   LIG    1        3.717  -0.870   0.116  0.00  0.00    +0.021 A 
ATOM      3  C   LIG    1        2.501  -0.271  -0.247  0.00  0.00    -0.017 A 
ATOM      4  C   LIG    1        2.317   1.115  -0.028  0.00  0.00    -0.017 A 
ATOM      5  C   LIG    1        1.099   1.710  -0.393  0.00  0.00    +0.020 A 
ATOM      6  C   LIG    1        0.062   0.952  -0.958  0.00  0.00    +0.018 A 
ATOM      7  C   LIG    1        0.256  -0.412  -1.184  0.00  0.00    +0.012 A 
ATOM      8  C   LIG    1        3.351   1.867   0.554  0.00  0.00    +0.009 A 
ATOM      9  C   LIG    1        1.464  -1.018  -0.825  0.00  0.00    +0.009 A 
ATOM     10  C   LIG    1        4.557   1.262   0.912  0.00  0.00    +0.013 A 
ENDROOT
BRANCH   1  13
ATOM     11  C   LIG    1        8.441  -0.825   1.171  0.00  0.00    +0.132 C 
ATOM     12  N   LIG    1        7.219  -0.242   0.644  0.00  0.00    -0.304 N 
ATOM     13  C   LIG    1        6.003  -0.774   1.068  0.00  0.00    +0.246 C 
ATOM     14  O   LIG    1        5.909  -1.776   1.774  0.00  0.00    -0.270 OA
ATOM     15  C   LIG    1        7.378   0.654  -0.493  0.00  0.00    +0.132 C 
ENDBRANCH   1  13
BRANCH   6  16
ATOM     16  C   LIG    1       -1.194   1.668  -1.323  0.00  0.00    +0.167 C 
ATOM     17  O   LIG    1       -1.101   2.843  -1.685  0.00  0.00    -0.292 OA
BRANCH  16  18
ATOM     18  C   LIG    1       -2.560   0.990  -1.265  0.00  0.00    +0.074 C 
ATOM     19  C   LIG    1       -2.782   0.142  -0.006  0.00  0.00    +0.095 C 
ATOM     20  N   LIG    1       -4.140  -0.419   0.105  0.00  0.00    -0.301 NA
ATOM     21  C   LIG    1       -4.770  -0.707  -1.194  0.00  0.00    +0.084 C 
ATOM     22  C   LIG    1       -3.753  -0.994  -2.298  0.00  0.00    +0.016 C 
ATOM     23  C   LIG    1       -2.879   0.232  -2.558  0.00  0.00    +0.014 C 
BRANCH  20  24
ATOM     24  C   LIG    1       -4.999   0.396   0.975  0.00  0.00    +0.088 C 
BRANCH  24  25
ATOM     25  C   LIG    1       -6.261  -0.339   1.327  0.00  0.00    +0.003 C 
ATOM     26  C   LIG    1       -6.844  -0.237   2.716  0.00  0.00    +0.005 C 
ATOM     27  C   LIG    1       -6.225  -1.528   2.256  0.00  0.00    +0.005 C 
ENDBRANCH  24  25
ENDBRANCH  20  24
ENDBRANCH  16  18
ENDBRANCH   6  16
TORSDOF 5